SCHEMBL8312308

SCHEMBL8312308

CC1(C)CCC(C)(C)c2cc3c(cc21)CCCC3CCO

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.39
MTNR1B P49286 2/20 0.39
NQO2 P16083 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8309891 0.82 FFAR1 (0.46)
SCHEMBL8309889 0.82 FFAR1 (0.46)
SCHEMBL8311004 0.81 ACHE (0.37) MTNR1AMTNR1BNQO2
SCHEMBL8311006 0.81 ACHE (0.37) MTNR1AMTNR1BNQO2
SCHEMBL8308287 0.80 RXRA (0.35)
SCHEMBL6037041 0.72 RXRA (0.52)
SCHEMBL21293949 0.71 CHRM4 (0.36)
SCHEMBL5172930 0.71 SIGMAR1 (0.61)
SCHEMBL6939291 0.69 RXRA (0.36)
SCHEMBL8308767 0.69 RXRA (0.36)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0933351-A1 Tricyclic retinoids, methods for their production and use LIGAND PHARMACEUTICALS INCORPORATED (US) 1999-08-04 EP disclosed
EP-0933350-A1 Tricyclic retinoids, methods for their production and use LIGAND PHARMACEUTICALS INCORPORATED (US) 1999-08-04 EP disclosed
US-5770382-A RETINOIC ACID AND RETINOID X RECEPTOR AGONISTS; TREATINGSKIN, EYE, BRAIN, AND CARDIOVASCULAR DISORDERS; CANCER LIGAND PHARMACEUTICALS, INC. (US) 1998-06-23 US disclosed
US-5770378-A A VITAMINE A METABOLITE, POTENT DRUGS TREATING SKIN DISEASES, CANCER, EYE DISEASES, CARDIOVASCULAR DISORDERS LIGAND PHARMACEUTICALS, INC. (US) 1998-06-23 US disclosed
US-5770383-A ACTIVATE RETINOID RECEPTORS LIGAND PHARMACEUTICALS, INC. (US) 1998-06-23 US disclosed
EP-0800504-A1 TRICYCLIC RETINOIDS, METHODS FOR THEIR PRODUCTION AND USE LIGAND PHARMACEUTICALS, INC. (US) 1997-10-15 EP disclosed
US-5612178-A Method of quantitative enzyme determination ABBOTT LABORATORIES (US) 1997-03-18 US disclosed
WO-1996020914-A1 TRICYCLIC RETINOIDS, METHODS FOR THEIR PRODUCTION AND USE LIGAND PHARMACEUTICALS INCORPORATED (US) 1996-07-11 WO disclosed
EP-0315058-B1 Method for self-performing enzyme kinetics ABBOTT LAB (US) 1994-06-22 EP disclosed
EP-0315058-A2 Method for self-performing enzyme kinetics ABBOTT LABORATORIES (US) 1989-05-10 EP disclosed
US-4801535-A DETECTION OF ASPARTATE AMINOTRANSFERASE XYTRONYX, INC. (US) 1989-01-31 US disclosed
EP-0263145-A4 METHOD FOR DETECTION OF PERIODONTAL DISEASE. XYTRONYX INC (US) 1989-01-26 EP disclosed
EP-0263145-A1 METHOD FOR DETECTION OF PERIODONTAL DISEASE XYTRONYX, INC. (US) 1988-04-13 EP disclosed
WO-1987005633-A1 METHOD FOR DETECTION OF PERIODONTAL DISEASE XYTRONYX, INC. (US) 1987-09-24 WO disclosed